Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 15/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 13/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 11/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | TSPO | P30536 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1880296 | 0.82 | CHRM3 (0.46) | CHRM3CHRM2CHRM1CHRM4CHRM5 | |
| SCHEMBL1873958 | 0.81 | SLC6A3 (0.44) | CHRM3CHRM2KCNH2SLC6A3SLC6A2 | |
| SCHEMBL1878142 | 0.81 | SLC6A3 (0.44) | CHRM3CHRM2KCNH2SLC6A3SLC6A2 | |
| SCHEMBL9671210 | 0.71 | SLC6A3 (0.36) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL20476343 | 0.69 | CHRM3 (0.55) | CHRM3CHRM2CHRM1CHRM4CHRM5 | |
| SCHEMBL27861451 | 0.69 | SLC6A3 (0.40) | SLC6A3SLC6A2SLC6A4DHFR | |
| SCHEMBL2596407 | 0.68 | CHRM3 (0.57) | CHRM3CHRM2CHRM1CHRM4CHRM5 | |
| Acetic Acid SCHEMBL20476349 | 0.68 | CHRM3 (0.54) | CHRM3CHRM2CHRM1CHRM4CHRM5 | |
| SCHEMBL826276 | 0.68 | CHRM3 (0.49) | CHRM3CHRM2CHRM1CHRM4CHRM5 | |
| Fluoride SCHEMBL14940626 | 0.67 | CHRM3 (0.56) | CHRM3CHRM2CHRM1CHRM4CHRM5 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7947730-B2 | Piperidinium and pyrrolidinium derivatives as ligands for the muscarinic M3 receptor | NOVARTIS AG (CH) | 2011-05-24 | — | — | US | disclosed |